CID 2809744

N-(tetrahydrofuran-2-ylmethyl)quinoline-8-sulfonamide

Structural Information

Molecular Formula
C14H16N2O3S
SMILES
C1CC(OC1)CNS(=O)(=O)C2=CC=CC3=C2N=CC=C3
InChI
InChI=1S/C14H16N2O3S/c17-20(18,16-10-12-6-3-9-19-12)13-7-1-4-11-5-2-8-15-14(11)13/h1-2,4-5,7-8,12,16H,3,6,9-10H2
InChIKey
JHXQMSIJNVPFRN-UHFFFAOYSA-N
Compound name
N-(oxolan-2-ylmethyl)quinoline-8-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

3
Patents

292.08817 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.095446 163.1
[M+Na]+ 315.077388 170.4
[M-H]- 291.080894 169.9
[M+NH4]+ 310.121993 178.7
[M+K]+ 331.051328 167.5
[M+H-H2O]+ 275.085430 156.3
[M+HCOO]- 337.086371 178.8
[M+CH3COO]- 351.102021 197.8
[M+Na-2H]- 313.062836 168.7
[M]+ 292.08762142 164.6
[M]- 292.08871858 164.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe